1-ethoxy-1,1-difluoropentane

C7H14F2O — CID 21052612

IUPAC1-ethoxy-1,1-difluoropentane
SMILESCCCCC(F)(F)OCC
InChIInChI=1S/C7H14F2O/c1-3-5-6-7(8,9)10-4-2/h3-6H2,1-2H3
InChIKeyCULJIBGPKGSTSP-UHFFFAOYSA-N
MW152.18 g/mol
LogP2.81
Rot. Bonds5

About 1-ethoxy-1,1-difluoropentane

1-ethoxy-1,1-difluoropentane (PubChem CID 21052612) has the molecular formula C7H14F2O and a molecular weight of 152.18 g/mol. Its IUPAC name is 1-ethoxy-1,1-difluoropentane.

Molecular Properties

Compound Name1-ethoxy-1,1-difluoropentane
PubChem CID21052612
Molecular FormulaC7H14F2O
Molecular Weight152.18 g/mol
Exact Mass152.10
IUPAC Name1-ethoxy-1,1-difluoropentane
SMILESCCCCC(F)(F)OCC
InChIInChI=1S/C7H14F2O/c1-3-5-6-7(8,9)10-4-2/h3-6H2,1-2H3
InChIKeyCULJIBGPKGSTSP-UHFFFAOYSA-N
XLogP2.81
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.18
LogP ≤ 52.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1-ethoxy-1,1-difluorobutane;fluoromethane
CID 91368772
1-(1,1-difluoropentoxy)-1,1-difluoropentane
CID 121434513
1-ethoxy-1,1-difluoro-5-methylheptane
CID 173466732
2,2-dibutylhexane-1,1,1-triol;1,1,1-triethoxyethane
CID 175727571
5,5-difluorononane
CID 21410163
4-propyl-4-(triethoxymethyl)dodecane
CID 151365628
1-ethoxy-1,1-difluoro-2-iodoethane
CID 119095748
2-ethoxyhexan-2-ylsilane
CID 150368773
iron(3+);1,1,1-trifluoropentane
CID 161198772
1,1-diethoxy-N-methylpentan-1-amine
CID 174342142
3-dimethylphosphoryloxy-1-ethoxy-1,1-difluoropropane
CID 89445600
1,1-difluorohexoxymethylbenzene
CID 67797942

Frequently Asked Questions

What is the IUPAC name of 1-ethoxy-1,1-difluoropentane?
The IUPAC name of 1-ethoxy-1,1-difluoropentane (CID 21052612) is 1-ethoxy-1,1-difluoropentane.
What is the SMILES notation for 1-ethoxy-1,1-difluoropentane?
The canonical SMILES for 1-ethoxy-1,1-difluoropentane is CCCCC(F)(F)OCC.
What is the InChIKey of 1-ethoxy-1,1-difluoropentane?
The InChIKey is CULJIBGPKGSTSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14F2O/c1-3-5-6-7(8,9)10-4-2/h3-6H2,1-2H3.
What are the key properties of 1-ethoxy-1,1-difluoropentane?
1-ethoxy-1,1-difluoropentane has a molecular weight of 152.18 g/mol, XLogP of 2.81, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethoxy-1,1-difluoropentane is sourced from PubChem (CID 21052612), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).